In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 1st, 2009 | 30 | No |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 2.91 | 8.25 | -70.95 | 1 | 6 | 1 | 78 | 430.477 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.91 | 5.45 | -19.53 | 0 | 6 | 0 | 77 | 429.469 | 2 | ↓ |